4-chloranyl-2-[dimethyl(sulfonato)azaniumyl]-1-[(4-nitrophenyl)carbamoyl]benzene

Systemtic Name: 4-chloranyl-2-[dimethyl(sulfonato)azaniumyl]-1-[(4-nitrophenyl)carbamoyl]benzene Openeye Name: 4-chloro-2-[dimethyl(sulfonato)ammonio]-1-[(4-nitrophenyl)carbamoyl]benzene CAS Name: 4-chloro-2-[dimethyl(sulfonato)ammonio]-1-[(4-nitroanilino)-oxomethyl]benzene IUPAC Name: 4-chloro-2-[dimethyl(sulfonato)azaniumyl]-1-[(4-nitrophenyl)carbamoyl]benzene Traditional Name: 4-chloro-2-[dimethyl(sulfonato)ammonio]-1-[(4-nitrophenyl)carbamoyl]benzene Formula: C15H14ClN3O6S MolecularWeight: 399.80616

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C1=C(C=CC(=C1)Cl)C(=O)NC2=CC=C(C=C2)[N+](=O)[O-])S(=O)(=O)[O-]

Isomeric SMILES

C[N+](C)(C1=C(C=CC(=C1)Cl)C(=O)NC2=CC=C(C=C2)[N+](=O)[O-])S(=O)(=O)[O-]

InChI

InChI=1S/C15H14ClN3O6S/c1-19(2,26(23,24)25)14-9-10(16)3-8-13(14)15(20)17-11-4-6-12(7-5-11)18(21)22/h3-9H,1-2H3,(H-,17,20,23,24,25)